Grundinformationen
- CAS
1489-56-1- Standard-SMILES
CC1=CC=CCC1- InChIKey
QMFJIJFIHIDENY-UHFFFAOYSA-N- Summenformel
- C7H10
- Durchschnittliche Molmasse
- 94,15 g/mol
- Monoisotopische Masse
- 94,07825032
Überblick
1-Methyl-1,3-cyclohexadiene is a hydrocarbon.
Namen und Bezeichner
- Bevorzugter Name
- 1-Methylcyclohexa-1,3-diene
- IUPAC
- 1-methylcyclohexa-1,3-diene
- Lokaler Name
- 2,3-Dihydrotoluol
- Englischer Name
- 1-Methyl-1,3-cyclohexadiene
- Summenformel
- C7H10
- Molmasse
- 94.15
Namen und Synonyme
1-Methyl-1,3-cyclohexadiene1-Methylcyclohexa-1,3-diene1489-56-15,6-DihydrotolueneMethylcyclohexadiene2,3-Dihydrotoluene1,3-Cyclohexadiene, 1-methyl-30640-46-1Cyclohexadiene, methyl-lemon hexadieneNZ9H475GT1EINECS 216-071-8
Weitere Namen anzeigen
1-MEthyl-cyclohexa-1,3-diene
DTXSID70892095EINECS 250-269-5LimedieneFEMA NO. 4311, METHYLCYCLOHEXADIENE-RefChem:43457694UK140GDPDTXCID4030548DTXSID1051985
Datenbank-Bezeichner
- CAS
1489-56-1、30640-46-1- PubChem CID
- 121731
- DTXSID
DTXSID70892095- ChEBI
CHEBI:165805- UNII
- NZ9H475GT1
- EC Number
- 216-071-8、250-269-5
- Nikkaji
- J206.693I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,1
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 0
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 107
Experimentelle und physikochemische Eigenschaften
FragrancesFragrance Ingredient (Methyl cyclohexadiene (mixture of isomers)) -> IFRA transparency List
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density
0.846-0.853
0.830-0.837
Flavoring AgentsEU Flavoring substances
Solubility
Insoluble in water; soluble in most fixed oils
Soluble (in ethanol)
Practically insoluble to insoluble
Slightly Soluble (in ethanol)
Boiling Point
118.00 to 120.00 °C. @ 760.00 mm Hg
118-120 °C
105 °C
Refractive Index
1.446-1.452
1.474-1.484
Physical Description
Colourless oily liquid; Light fruity aroma
Colorless liquid, Strong lemon-lime top note
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P301+P316, P303+P361+P353, P331, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 131 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
Gefahrenhinweise
Regulatory Information
Chemical: 1,3-Cyclohexadiene, 1-methyl-
Chemical: Cyclohexadiene, methyl-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Cyclohexadiene, methyl-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and Categories
Flam. Liq. 2 (100%)
Flam. Liq. 2 (100%)
Sicherheitsdaten
- tsca
- TSCA listed
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsMembrane
Verwendung und Herstellung
Use Classification
Fragrance Ingredients
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
General Manufacturing Information
1,3-Cyclohexadiene, 1-methyl-: INACTIVE
Cyclohexadiene, methyl-: ACTIVE
Anwendungen
BeschreibungBy dehalogenation of 1,2-dibromo-l-methyl cyclohexane with sodium ethoxide; purified by distillation over metallic sodium.
Vor- und nachgelagerte Produkte
Nachgelagerte Produkte
Anbieter8 Anbieter
苏州启航生物科技有限公司18151111370
韶远科技(上海)有限公司4000665055 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
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